methyl N-(3-{[5-methyl-2-(pyridin-4-yl)-1H-imidazol-1-yl]methyl}azetidine-1-carbonyl)valinate
Chemical Structure Depiction of
methyl N-(3-{[5-methyl-2-(pyridin-4-yl)-1H-imidazol-1-yl]methyl}azetidine-1-carbonyl)valinate
methyl N-(3-{[5-methyl-2-(pyridin-4-yl)-1H-imidazol-1-yl]methyl}azetidine-1-carbonyl)valinate
Compound characteristics
| Compound ID: | S696-1528 |
| Compound Name: | methyl N-(3-{[5-methyl-2-(pyridin-4-yl)-1H-imidazol-1-yl]methyl}azetidine-1-carbonyl)valinate |
| Molecular Weight: | 385.46 |
| Molecular Formula: | C20 H27 N5 O3 |
| Smiles: | CC(C)C(C(=O)OC)NC(N1CC(C1)Cn1c(C)cnc1c1ccncc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3716 |
| logD: | 2.3688 |
| logSw: | -2.1221 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.367 |
| InChI Key: | NSBMNHYIXQDYCH-KRWDZBQOSA-N |